2-methylsulfanyl-4-(oxolan-2-ylmethylamino)pyrimidine-5-carboxylic acid

Systemtic Name: 2-methylsulfanyl-4-(oxolan-2-ylmethylamino)pyrimidine-5-carboxylic acid Openeye Name: 2-methylsulfanyl-4-(tetrahydrofuran-2-ylmethylamino)pyrimidine-5-carboxylic acid CAS Name: 2-(methylthio)-4-(2-oxolanylmethylamino)-5-pyrimidinecarboxylic acid IUPAC Name: 2-methylsulfanyl-4-(oxolan-2-ylmethylamino)pyrimidine-5-carboxylic acid Traditional Name: 2-(methylthio)-4-(tetrahydrofurfurylamino)pyrimidine-5-carboxylic acid Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NCC2CCCO2)C(=O)O

Isomeric SMILES

CSC1=NC=C(C(=N1)NCC2CCCO2)C(=O)O

InChI

InChI=1S/C11H15N3O3S/c1-18-11-13-6-8(10(15)16)9(14-11)12-5-7-3-2-4-17-7/h6-7H,2-5H2,1H3,(H,15,16)(H,12,13,14)